(E)-2-(4-azanylpiperidin-1-yl)carbonyl-3-(5-chloranyl-2-oxidanyl-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(4-azanylpiperidin-1-yl)carbonyl-3-(5-chloranyl-2-oxidanyl-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(4-aminopiperidine-1-carbonyl)-3-(5-chloro-2-hydroxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-[(4-amino-1-piperidinyl)-oxomethyl]-3-(5-chloro-2-hydroxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(4-aminopiperidine-1-carbonyl)-3-(5-chloro-2-hydroxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(4-aminopiperidine-1-carbonyl)-3-(5-chloro-2-hydroxy-phenyl)acrylonitrile Formula: C15H16ClN3O2 MolecularWeight: 305.75944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N)C(=O)C(=CC2=C(C=CC(=C2)Cl)O)C#N

Isomeric SMILES

C1CN(CCC1N)C(=O)/C(=C/C2=C(C=CC(=C2)Cl)O)/C#N

InChI

InChI=1S/C15H16ClN3O2/c16-12-1-2-14(20)10(8-12)7-11(9-17)15(21)19-5-3-13(18)4-6-19/h1-2,7-8,13,20H,3-6,18H2/b11-7+